Chemical ID: 5280766

COc1cc(cc(c1OC)OC)C=C2C(=O)c3ccc(cc3O2)OCC#N
Chemical ID:
5280766
Name [?]:
2-[3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]benzofuran-6-yl]oxyacetonitrile
SMILES [?]:
COc1cc(cc(c1OC)OC)C=C2C(=O)c3ccc(cc3O2)OCC#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H17NO6
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:5.83346
Area:576.169
Solvation:-8.57077
Coulombic:-48.2964
Bond Count [?]
All:29
Single:20
Double:8
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:367.352
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:2.38
LogP (Chemaxon):2.2

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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